SCHEMBL149366

SCHEMBL149366

CCCCCCc1nc2c([nH]1)C(=O)N(C)C1=N[C@@H]3CCC[C@@H]3N12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 12/20 1.00
▸ PDE3B Q13370 9/20 1.00
▸ PDE3A Q14432 9/20 1.00
▸ PDE4A P27815 4/20 1.00
▸ PDE4B Q07343 4/20 1.00
▸ PDE4C Q08493 4/20 1.00
▸ PDE4D Q08499 4/20 1.00

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2436275 1.00 PDE5A (1.00) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL149367 1.00 PDE5A (1.00) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL149365 1.00 PDE5A (1.00) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL4751642 0.80 PDE5A (0.66) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL4751641 0.80 PDE5A (0.66) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL10201496 0.79 PDE5A (1.00) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL10201620 0.79 PDE5A (0.84) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL236618 0.78 PDE5A (1.00) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL236619 0.78 PDE5A (1.00) PDE5APDE3BPDE3APDE4APDE4B
SCHEMBL236620 0.78 PDE5A (1.00) PDE5APDE3BPDE3APDE4APDE4B

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 412 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II BAUSCH HEALTH IRELAND LIMITED (F/K/A/ VALEANT PHARMACEUTICALS IRELAND LIMITED) (IE) 2015-11-12 — — US claimed
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. (US) 2013-08-08 — — US claimed
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II SPROUT PHARMACEUTICALS, INC. 2011-05-05 — — US claimed
US-20100267735-A1 METHODS AND COMPOSITIONS TO ENHANCE THE EFFICACY OF PHOSPHODIESTERASE INHIBITORS THOMAS THOMAS N 2010-10-21 — — US claimed
US-20100267736-A1 METHODS AND COMPOSITIONS TO ENHANCE THE EFFICACY OF PHOSPHODIESTERASE INHIBITORS THOMAS THOMAS N 2010-10-21 — — US claimed
US-20100179152-A1 Novel use for PDE5 inhibitors NYCOMED GMBH (DE) 2010-07-15 — — US claimed
US-7737147-B2 Methods and compositions to enhance the efficacy of phosphodiesterase inhibitors THOMAS THOMAS NADACKAL 2010-06-15 — — US claimed
EP-1740183-B1 NOVEL USE FOR PDE5 INHIBITORS NYCOMED GMBH (DE) 2009-10-14 — — EP claimed
US-20080103155-A1 Pharmaceutical compositions for the treatment of sexual disorders II SPROUT PHARMACEUTICALS, INC. 2008-05-01 — — US claimed
US-20070185114-A1 Novel use for pde5 inhibitors ALTANA PHARMA AG (DE) 2007-08-09 — — US claimed
EP-1237577-A2 TRANSMUCOSAL COMPOSITION CONTAINING A PHOSPHODIESTERASE INHIBITOR FOR THE TREATMENT OF ERECTILE DYSFUNCTION Vivus, Inc. (US) 2002-09-11 — — EP claimed
US-6403597-B1 PRETREATMENT SEXUAL INTERCOURSE VIVUS, INC. 2002-06-11 — — US claimed
EP-1199070-A2 Use of PDE V inhibitors for improved fecundity in mammals Pfizer Limited (GB) 2002-04-24 — — EP claimed
US-20020037828-A1 Administration of phosphodiesterase inhibitors for the treatment of premature ejaculation VIVUS, INC. 2002-03-28 — — US claimed
US-20020004498-A1 Transmucosal administration of phosphodiesterase inhibitors for the treatment of erectile dysfunction DOHERTY PAUL C (US) 2002-01-10 — — US claimed
WO-2001070211-A2 L-ARGININE AND PHOSPHODIESTERASE (PDE) INHIBITOR SYNERGISM THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-09-27 — — WO claimed
WO-2001041807-A2 TRANSMUCOSAL COMPOSITION CONTAINING A PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION VIVUS, INC. (US) 2001-06-14 — — WO claimed
EP-1027054-A1 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION Vivus, Inc. (US) 2000-08-16 — — EP claimed
US-6037346-A Local administration of phosphodiesterase inhibitors for the treatment of erectile dysfunction VIVUS, INC. (US) 2000-03-14 — — US claimed
WO-1999021558-A2 LOCAL ADMINISTRATION OF PHOSPHODIESTERASE INHIBITORS FOR THE TREATMENT OF ERECTILE DYSFUNCTION VIVUS, INC. (US) 1999-05-06 — — WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080103155-A1 Pharmaceutical compositions for the treatment of sexual disorders II FLNB, FLNA, FGB PDE5A 27/4885PDE3B 4/4885PDE3A 11/4885
US-20020004498-A1 Transmucosal administration of phosphodiesterase inhibitors for the treatment of erectile dysfunction PDE3A, PDE5A, PDE3B PDE5A 2/4885PDE3B 3/4885PDE3A 1/4885
US-20020037828-A1 Administration of phosphodiesterase inhibitors for the treatment of premature ejaculation PDE5A, PDE3B, PDE3A PDE5A 1/4885PDE3B 2/4885PDE3A 3/4885
US-20130203766-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB PDE5A 27/4885PDE3B 4/4885PDE3A 11/4885
US-20110105519-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB PDE5A 27/4885PDE3B 4/4885PDE3A 11/4885
US-20150320739-A1 Pharmaceutical Compositions for the Treatment of Sexual Disorders II FLNB, FLNA, FGB PDE5A 27/4885PDE3B 4/4885PDE3A 11/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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